Vitas-M small molecule compound
11-(6,8-dichloro-4-oxo-4H-chromen-3-yl)-3-(4-methoxyphenyl)-2,3,4,5,10,11-hexahydro-1H-dibenzo[b,e][1,4]diazepin-1-one
Catalog ID
STK101224
SMILES COc1ccc(cc1)C1CC(=O)C2=C(C1)Nc1ccccc1NC2c1coc2c(c1=O)cc(cc2Cl)Cl
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We supply compounds in quantities from 1 mg up to 5 g for research and development purposes only.
We do not supply quantities above 5 g.
Structure and other identifiers
2D representation rendered from the SMILES, with core physicochemical data.Formula C29H22Cl2N2O4 MW 533.41 g/mol Purity >90% as per NMR
InChI
InChI=1S/C29H22Cl2N2O4/c1-36-18-8-6-15(7-9-18)16-10-24-26(25(34)11-16)27(33-23-5-3-2-4-22(23)32-24)20-14-37-29-19(28(20)35)12-17(30)13-21(29)31/h2-9,12-14,16,27,32-33H,10-11H2,1H3InChIKey
NYBVZQLZJCWAEK-UHFFFAOYSA-NSynonyms
11(68dichloro4oxo4Hchromen3yl)3(4methoxyphenyl)23451011hexahydro1Hdibenzo(be)(14)diazepin1one
6(68dichloro4oxochromen3yl)9(4methoxyphenyl)56891011hexahydrobenzo(b)(14)benzodiazepin7one
68DICHLORO3(3(4METHOXYPHENYL)1OXO(234TRIHYDRO5H10H11HBENZO(B)BENZO(21F)14DIAZEPIN11YL))CHROMEN4ONE
COC1=CC=C(C=C1)C2CC3=C(C(NC4=CC=CC=C4N3)C5=COC6=C(C=C(C=C6C5=O)Cl)Cl)C(=O)C2
InChI=1SC29H22Cl2N2O4c136188615(7918)16102426(25(34)1116)27(3323532422(23)3224)2014372919(28(20)35)1217(30)1321(29)31h29121416273233H1011H21H3
MFCD02068200
ZINC000004081990
ZINC000004081994
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